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Compound Detail

CHEMBL1180598

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Nc1cccc(OCCCNCC2CCc3ccccc3O2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1180598
Phase Preclinical
Structure Type MOL
InChI Key LZDHUMNPJASCMA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

312.4
MW (Da)
3.02
ALogP
4
HBA
2
HBD
56.5
PSA (Ų)
0.61
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H24N2O2
MW 312.41
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.30

Data from ChEMBL 36 via Core Engine